methyl 3-[4-[5-(4-cyanophenyl)-1,3,4-thiadiazol-2-yl]phenyl]propanoate

Systemtic Name: methyl 3-[4-[5-(4-cyanophenyl)-1,3,4-thiadiazol-2-yl]phenyl]propanoate Openeye Name: methyl 3-[4-[5-(4-cyanophenyl)-1,3,4-thiadiazol-2-yl]phenyl]propanoate CAS Name: 3-[4-[5-(4-cyanophenyl)-1,3,4-thiadiazol-2-yl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[5-(4-cyanophenyl)-1,3,4-thiadiazol-2-yl]phenyl]propanoate Traditional Name: 3-[4-[5-(4-cyanophenyl)-1,3,4-thiadiazol-2-yl]phenyl]propionic acid methyl ester Formula: C19H15N3O2S MolecularWeight: 349.4063

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(C=C1)C2=NN=C(S2)C3=CC=C(C=C3)C#N

Isomeric SMILES

COC(=O)CCC1=CC=C(C=C1)C2=NN=C(S2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H15N3O2S/c1-24-17(23)11-6-13-2-7-15(8-3-13)18-21-22-19(25-18)16-9-4-14(12-20)5-10-16/h2-5,7-10H,6,11H2,1H3